N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide

C16H24N4O3 — CID 3838021

IUPACN-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide
SMILESO=C(NC1CCCCC1)N1CCOC(COc2ncccn2)C1
InChIInChI=1S/C16H24N4O3/c21-16(19-13-5-2-1-3-6-13)20-9-10-22-14(11-20)12-23-15-17-7-4-8-18-15/h4,7-8,13-14H,1-3,5-6,9-12H2,(H,19,21)
InChIKeyDUTPDGSOBIJXLL-UHFFFAOYSA-N
MW320.39 g/mol
LogP1.60
Rot. Bonds4

About N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide

N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide (PubChem CID 3838021) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide
PubChem CID3838021
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC NameN-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide
SMILESO=C(NC1CCCCC1)N1CCOC(COc2ncccn2)C1
InChIInChI=1S/C16H24N4O3/c21-16(19-13-5-2-1-3-6-13)20-9-10-22-14(11-20)12-23-15-17-7-4-8-18-15/h4,7-8,13-14H,1-3,5-6,9-12H2,(H,19,21)
InChIKeyDUTPDGSOBIJXLL-UHFFFAOYSA-N
XLogP1.60
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-2-(hydroxymethyl)morpholine-4-carboxamide
CID 79832616
2-(pyrimidin-2-yloxymethyl)-N-(2-thiophen-2-ylethyl)morpholine-4-carboxamide
CID 5009855
2-(5-bromo-3-pyridinyl)-1-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]ethanone
CID 74228366
N-(4-methyl-2-pyridinyl)-4-oxo-4-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]butanamide
CID 74225435
3-[3-oxo-3-[2-(pyrimidin-2-yloxymethyl)morpholin-4-yl]propyl]-1,3-benzoxazol-2-one
CID 74225543
N-cycloheptyl-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108990409
N-cyclohexyl-3-(1,2,4-oxadiazol-3-yl)pyrrolidine-1-carboxamide
CID 121019590
4-[[2-(hydroxymethyl)morpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 81204653
2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
CID 110327090
N-cyclohexyl-2-(4-ethylphenyl)morpholine-4-carboxamide
CID 110364020
N-(oxan-4-yl)-2-(2-phenylethyl)morpholine-4-carboxamide
CID 126776750
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide?
The IUPAC name of N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide (CID 3838021) is N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide is O=C(NC1CCCCC1)N1CCOC(COc2ncccn2)C1.
What is the InChIKey of N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide?
The InChIKey is DUTPDGSOBIJXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3/c21-16(19-13-5-2-1-3-6-13)20-9-10-22-14(11-20)12-23-15-17-7-4-8-18-15/h4,7-8,13-14H,1-3,5-6,9-12H2,(H,19,21).
What are the key properties of N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide?
N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(pyrimidin-2-yloxymethyl)morpholine-4-carboxamide is sourced from PubChem (CID 3838021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).